File name: Pandora132s1_Berlin_20221231_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T185432.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20221231_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20221231 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20221231T092618.1Z 8400.393265 163 1 49.56 2 78.84 155.87 106.34 51.90 0.00 1 0.00 1 0 17 3.946e-01 2.742e-02 4.288e-01 2.732e-02 6.676532e-01 1.467164e-02 8.199813e-03 -6.000000e+00 2.221894e-01 220.82 -2.00 3.85 -2.00 321.25 0.00e+00 1.094871e-02 5.993163e-03 2.135077e-03 -6.000000e+00 1.030470e-02 266.80 -2.00 20.00 -2.00 320.82 0.00e+00 4.992 0.003 302.00 328.00 3 3.9380e+00 4.5098e-02 6.4205e-02 -6.0000e+00 5.4834e-01 4.1692e-01 5.6876e-02 4.6443e-02 -6.0000e+00 6.0274e-01 -4.6194e-01 5.5464e-02 1.9968e-02 -6.0000e+00 3.5613e-01 1.9553e-01 2.7873e-02 1.1845e-02 -6.0000e+00 1.5124e-01 3.4018e-05 -2.0243e-03 7.9096e-04 1.1064e-04 -6.0000e+00 1.1111e-02 -2.4319e-02 0.0000e+00 12 8 8 10 0 0 99.99 16.82 0.81 -0.02432 -0.03953 76 16 2 8 0 651.940 15.02 16.82 21.96 21.17 21.58 27.3 1051.64 -14911 900000 -194636 900000 900000 -89501 -48135 96575 900000 -75711 36354 -41625 900000 13379 -31708 216428 -20359 900000 -40004 900000 25968 -62145 -119225 83572 108568 -7968 109147 -37600 86284 27117 900000 6489 -27489 19131 -24898 75285 -20469 79651 23651 -6611 8121 19935 -13054 13970 59011 4705 16688 -2778 3594 16052 21712 12401 12859 12115 18661 23633 5411 12244 -9402 -4904 6633 -4232 10160 16512 15555 -7420 6846 -4908 10034 -4795 10399 10673 -458 9624 1658 8313 -8159 1134 -7659 2339 -2623 -3885 4010 -2503 -721 -3315 2792 -3995 1705 1472 -266 337 -6340 4195 -3231 -1422 -773 2465 408 310 -182 -1802 344 -2496 432 -1078 -1407 -3754 -1415 -1734 -1782 -318 -2664 -340 -2105 319 2120 865 58 -813 3799 251 5216 -186 2194 -1170 -423 4156 1065 1955 235 1743 -1875 524 -1200 -1043 873 -136 1644 -1496 1288 -2293 -1118 -397 900000 -9492 900000 900000 -2381 -1280 2569 900000 -2014 967 -1107 900000 356 -843 5757 -591 900000 -1644 900000 691 -3156 -10667 2223 2888 -250 2903 -1546 2295 721 900000 282 -1928 879 -1686 2003 -1386 2311 1430 -623 727 1687 -1610 1351 3710 523 1695 -356 452 1902 2678 1859 2083 2109 3159 3886 1073 2221 -2046 -1008 1267 -1003 2383 4073 4062 -2386 1871 -1555 3033 -1913 3873 4078 -190 3375 569 2392 -2604 340 -2852 939 -1294 -2199 2279 -1604 -481 -2405 1998 -3130 1249 1036 -177 208 -4047 2516 -2360 -1190 -746 2404 439 333 -182 -1782 306 -2306 414 -1108 -1531 -4485 -1671 -2310 -2618 -485 -4145 -497 -2958 459 3030 1312 86 -1251 5989 392 7455 -271 3008 -1593 -558 5527 1653 3398 453 3511 -3770 1191 -2702 -2447 2046 -324 4159 -3737 2922 -5039 -2366 SS 20221231T093141.7Z 8400.397011 166 1 21.83 2 78.51 157.09 105.69 53.06 0.00 1 0.00 1 0 17 3.842e-01 6.991e-03 1.196e-01 2.992e-03 6.550029e-01 1.558937e-03 7.975949e-03 -6.000000e+00 2.139530e-01 220.82 -2.00 3.85 -2.00 321.10 0.00e+00 3.486168e-03 6.412687e-04 6.879724e-04 -6.000000e+00 9.101442e-03 266.80 -2.00 20.00 -2.00 320.70 0.00e+00 4.860 0.002 302.00 328.00 3 9.5516e-01 4.7682e-03 6.0006e-02 -6.0000e+00 5.2600e-01 9.8602e-02 6.4924e-03 3.7380e-02 -6.0000e+00 5.7632e-01 -7.1039e-02 7.2512e-03 2.0512e-02 -6.0000e+00 3.4190e-01 2.1592e-02 3.5938e-03 7.8406e-03 -6.0000e+00 1.4424e-01 8.5431e-04 -7.1720e-04 8.4435e-05 9.0132e-05 -6.0000e+00 1.0476e-02 -2.4627e-02 0.0000e+00 12 9 1 12 1 1 99.99 16.83 0.20 -0.02463 -0.03002 150 74 2 8 0 141.460 15.02 16.83 22.27 21.17 21.58 27.2 1053.28 -128796 -124206 -117392 -133910 -128108 -176381 -91130 -155437 -116108 -66664 -99146 -64019 -63501 -54029 -74428 -46686 -33858 -32613 -31654 -15917 -29300 -33801 -13854 -19550 -12354 -34044 -13300 -21913 -32061 -26971 -1362 -7225 -7541 4638 -10671 806 -12641 -3107 -5096 1312 3934 -925 1775 -1656 6605 2197 1510 2245 2553 5169 2409 6998 1622 5349 1422 4573 1552 1101 1022 444 2591 1856 4020 2569 3142 1309 1422 792 1911 2209 409 1375 -39 935 -470 -167 -800 -1998 -279 -1446 -451 -1689 -2049 -1835 -617 -849 35 581 429 797 287 621 -945 136 -699 -63 -63 581 382 -354 -141 -813 -42 -389 -1066 -1496 -1004 -728 230 415 203 21 86 68 -196 232 592 62 484 -293 181 21 733 108 466 36 -534 1181 423 167 -105 -188 -250 118 -207 -384 -44 311 67 -258 406 -353 -171 -854 -1015 -959 -1250 -1047 -2316 -558 -2086 -1186 -447 -984 -523 -667 -678 -1455 -831 -603 -638 -665 -302 -650 -789 -279 -456 -292 -1053 -338 -595 -973 -858 -41 -276 -334 192 -498 34 -671 -181 -373 107 350 -93 183 -181 678 242 173 266 318 617 330 1028 277 952 278 905 324 229 206 89 532 428 1038 753 958 398 427 250 669 882 182 625 -18 391 -181 -58 -263 -687 -108 -669 -242 -1039 -1378 -1307 -424 -621 26 449 328 581 214 432 -648 97 -567 -54 -63 649 460 -425 -156 -810 -39 -365 -1077 -1605 -1131 -878 304 613 331 33 146 111 -302 343 882 97 799 -501 302 34 1125 162 668 49 -726 1673 683 304 -194 -366 -512 256 -479 -930 -109 772 165 -609 891 -734 -349 SS 20221231T093650.6Z 8400.400585 168 1 51.11 2 78.22 158.26 105.06 54.16 0.00 1 0.00 1 0 17 3.592e-01 6.311e-03 6.885e-02 1.681e-03 6.428717e-01 8.728916e-04 7.754905e-03 -6.000000e+00 2.000791e-01 220.82 -2.00 3.85 -2.00 321.14 0.00e+00 3.418416e-03 3.633066e-04 6.744363e-04 -6.000000e+00 8.510384e-03 266.80 -2.00 20.00 -2.00 320.74 0.00e+00 4.747 0.002 302.00 328.00 3 4.2022e-01 2.6622e-03 5.8685e-02 -6.0000e+00 4.9190e-01 9.2947e-02 3.6690e-03 3.6816e-02 -6.0000e+00 5.3891e-01 -6.5915e-02 4.1318e-03 2.0329e-02 -6.0000e+00 3.1971e-01 1.8146e-02 2.0428e-03 7.9470e-03 -6.0000e+00 1.3491e-01 1.6446e-03 -5.1495e-04 4.7611e-05 8.2692e-05 -6.0000e+00 9.7949e-03 -2.6077e-02 0.0000e+00 10 0 0 10 0 0 99.68 16.85 0.20 -0.02608 -0.02995 579 123 2 8 0 84.740 15.03 16.85 22.67 21.17 21.58 27.4 1055.71 -92008 -122879 -84110 -145242 -110020 -137331 -118990 -121163 -112482 -81596 -125466 -80075 -91957 -37435 -59252 -22148 -35064 -28151 -28434 -25334 -13243 -32865 -17411 -24937 -12510 -19662 -18121 -25547 -24712 -11090 -9193 -83 -8126 -4343 -9600 -11523 -5362 -5690 4427 -586 4439 2309 2066 1592 829 2852 1325 6256 906 4927 3838 4357 3151 4141 3034 1907 2928 -29 663 -332 1244 2798 3375 3441 2101 1486 395 684 965 1987 779 1189 363 -125 -374 -1480 -125 -2271 -727 -1180 -903 -1131 -2269 -1609 -1321 -789 198 345 528 714 838 227 -452 -353 152 -334 85 857 307 -34 -170 -856 -480 214 -1081 -1466 -641 -547 154 317 408 -50 216 -239 15 114 577 178 179 -230 -250 133 798 56 557 117 -235 811 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